4-[(3,5-dimethylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid

Systemtic Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid Openeye Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid CAS Name: 4-[(3,5-dimethyl-1-pyrazolyl)methyl]-2-thiophenecarboxylic acid IUPAC Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]thiophene-2-carboxylic acid Traditional Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-2-thenoic acid Formula: C11H12N2O2S MolecularWeight: 236.29018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CSC(=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1CC2=CSC(=C2)C(=O)O)C

InChI

InChI=1S/C11H12N2O2S/c1-7-3-8(2)13(12-7)5-9-4-10(11(14)15)16-6-9/h3-4,6H,5H2,1-2H3,(H,14,15)